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Methyl 4-tert-butylbenzoate

View entire compound with spectra: 4 NMR, 3 FTIR, 1 Raman, and 4 MS (GC)

Methyl 4-tert-butylbenzoate
SpectraBase Compound ID KXajVh0IK16
InChI InChI=1S/C12H16O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3
InChIKey UPIJOAFHOIWPLT-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EffSNKux4Rc
Name Methyl 4-tert-butylbenzoate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 167533
CAS Registry Number 26537-19-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3
InChIKey UPIJOAFHOIWPLT-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_002043